Name: Name:1-ethyl-3-(4-nitrophenyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
Brand: Angene
SKU: AG00II0W
Rating: 90 (10 reviews)

1-ethyl-3-(4-nitrophenyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole

CAS No.:

942920-11-8

Catalog Number:

AG00II0W

Molecular Formula:

C17H22BN3O4

Molecular Weight:

343.1853

Catalog Number:

AG00II0W

Chemical Name:

1-ethyl-3-(4-nitrophenyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole

CAS Number:

942920-11-8

Molecular Formula:

C17H22BN3O4

Molecular Weight:

343.1853

MDL Number:

MFCD12400854

IUPAC Name:

1-ethyl-3-(4-nitrophenyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole

InChI:

InChI=1S/C17H22BN3O4/c1-6-20-11-14(18-24-16(2,3)17(4,5)25-18)15(19-20)12-7-9-13(10-8-12)21(22)23/h7-11H,6H2,1-5H3

InChI Key:

BNJLOSTYUZRZME-UHFFFAOYSA-N

SMILES:

CCn1cc(c(n1)c1ccc(cc1)[N+](=O)[O-])B1OC(C(O1)(C)C)(C)C

Complexity:

487

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

343.17g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

343.19g/mol

Monoisotopic Mass:

343.17g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

82.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: